VAR

9-amino-5-(2-aminopyrimidin-4-yl)pyrido[3',2':4,5]pyrrolo[1,2-c]pyrimidin-4-ol

Created:	2007-12-04
Last modified:	2011-06-04

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2 entries where VAR is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	33
Chiral Atom Count	0
Bond Count	36
Aromatic Bond Count	22

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Chemical Component Summary
Name	9-amino-5-(2-aminopyrimidin-4-yl)pyrido[3',2':4,5]pyrrolo[1,2-c]pyrimidin-4-ol
Systematic Name (OpenEye OEToolkits)	n/a
Formula	C₁₄ H₁₁ N₇ O
Molecular Weight	293.283
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	n1ccc(O)c2c1n4c(c2c3nc(ncc3)N)ccnc4N
SMILES	CACTVS	3.341	Nc1nccc(n1)c2c3ccnc(N)n3c4nccc(O)c24
SMILES	OpenEye OEToolkits	1.5.0	c1cnc(n2c1c(c3c2nccc3O)c4ccnc(n4)N)N
Canonical SMILES	CACTVS	3.341	Nc1nccc(n1)c2c3ccnc(N)n3c4nccc(O)c24
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1cnc(n2c1c(c3c2nccc3O)c4ccnc(n4)N)N
InChI	InChI	1.03	InChI=1S/C14H11N7O/c15-13-18-4-1-7(20-13)10-8-2-5-19-14(16)21(8)12-11(10)9(22)3-6-17-12/h1-6H,(H2,16,19)(H,17,22)(H2,15,18,20)
InChIKey	InChI	1.03	RTHKPHCVZVYDFN-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB08694
Name	Variolin B
Groups	experimental
Synonyms	Variolin B
Categories	Alkaloids

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Cyclin-dependent kinase 2	MENFQKVEKIGEGTYGVVYKARNKLTGEVVALKKIRLDTETEGVPSTAIR...	unknown
Cyclin-A2	MLGNSAPGPATREAGSALLALQQTALQEDQENINPEKAAPVQQPRTRAAL...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682